3-(3-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(3-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(3-methoxyphenyl)-5-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-(3-methoxyphenyl)-5-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-(3-methoxyphenyl)-5-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(3-methoxyphenyl)-5-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-4-phenyl-1,2,4-triazole Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SC=CC4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)S/C=C/C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O4S/c1-28-18-9-5-6-15(14-18)20-22-23-21(24(20)16-7-3-2-4-8-16)30-13-12-17-10-11-19(29-17)25(26)27/h2-14H,1H3/b13-12+